Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 4/20 | 0.38 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | THRA | P10827 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | NQO2 | P16083 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.35 |
| ▸ | S1PR5 | Q9H228 | 4/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14192531 | 0.85 | THRB (0.37) | GAAMAPTTHRATHRB | |
| SCHEMBL14192467 | 0.81 | L3MBTL1 (0.43) | CNR2BCHEGAAMAPT | |
| SCHEMBL14168937 | 0.78 | NPC1 (0.43) | ITGB3ITGA2BMAPTTHRATHRB | |
| SCHEMBL3620303 | 0.77 | THRB (0.54) | GAAMAPTTHRATHRB | |
| SCHEMBL3620302 | 0.77 | THRB (0.54) | GAAMAPTTHRATHRB | |
| SCHEMBL10578972 | 0.77 | NPC1 (0.47) | ITGB3ITGA2BS1PR1S1PR5S1PR3 | |
| SCHEMBL9592260 | 0.77 | SMN1; SMN2 (0.46) | ITGB3ITGA2BS1PR1S1PR5S1PR3 | |
| SCHEMBL9592253 | 0.77 | SMN1; SMN2 (0.46) | ITGB3ITGA2BS1PR1S1PR5S1PR3 | |
| SCHEMBL10578966 | 0.77 | NPC1 (0.47) | ITGB3ITGA2BS1PR1S1PR5S1PR3 | |
| SCHEMBL11320213 | 0.76 | TP53 (0.49) | S1PR1S1PR5S1PR3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7357964-B2 | Liquid-crystalline vinyl ketone derivatives and their polymers | CHISSO CORPORATION (JP) | 2008-04-15 | — | — | US | disclosed |